sodium 3-(aminomethyl)-4-sulfanyl-butane-1-sulfonate

Systemtic Name: sodium 3-(aminomethyl)-4-sulfanyl-butane-1-sulfonate Openeye Name: sodium 3-(aminomethyl)-4-sulfanyl-butane-1-sulfonate CAS Name: sodium 3-(aminomethyl)-4-mercapto-1-butanesulfonate IUPAC Name: sodium 3-(aminomethyl)-4-sulfanylbutane-1-sulfonate Traditional Name: sodium 3-(aminomethyl)-4-mercapto-butane-1-sulfonate Formula: C5H12NNaO3S2 MolecularWeight: 221.27345

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Descriptors Computed from Structure

Canonical SMILES:

C(CS(=O)(=O)[O-])C(CN)CS.[Na+]

Isomeric SMILES

C(CS(=O)(=O)[O-])C(CN)CS.[Na+]

InChI

InChI=1S/C5H13NO3S2.Na/c6-3-5(4-10)1-2-11(7,8)9;/h5,10H,1-4,6H2,(H,7,8,9);/q;+1/p-1